rel-(1R,5S)-8-(3-methoxybenzene-1-sulfonyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octane
Chemical Structure Depiction of
rel-(1R,5S)-8-(3-methoxybenzene-1-sulfonyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octane
rel-(1R,5S)-8-(3-methoxybenzene-1-sulfonyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octane
Compound characteristics
| Compound ID: | S253-0751 |
| Compound Name: | rel-(1R,5S)-8-(3-methoxybenzene-1-sulfonyl)-3-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octane |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C21 H22 N4 O4 S |
| Smiles: | COc1cccc(c1)S(N1[C@H]2CC[C@@H]1C[C@H](C2)c1nc(c2ccncc2)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.0352 |
| logD: | 3.0351 |
| logSw: | -3.0687 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.753 |
| InChI Key: | MNJZKDOFUPAFPJ-BJWYYQGGSA-N |